B3LYP/Def2-TZVPP, GD3BJ, TS chair OCH2Ph, trans alt pi-face from CO2Et structure TS 2nd step G = -1796.669178 ( -1796.676291) conformer 2 -1796.662947
收藏Mendeley Data2024-06-11 更新2024-06-27 收录
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https://data.hpc.imperial.ac.uk/resolve/?doi=14305
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资源简介:
Gaussian 16 (C01) calculation
高斯16(C01)计算
创建时间:
2024-06-02



